4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide

C15H23N3O — CID 54915908

IUPAC4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide
SMILESCCN1CCC(NC(=O)c2ccc(N)c(C)c2)CC1
InChIInChI=1S/C15H23N3O/c1-3-18-8-6-13(7-9-18)17-15(19)12-4-5-14(16)11(2)10-12/h4-5,10,13H,3,6-9,16H2,1-2H3,(H,17,19)
InChIKeyUAHQTXPYIZOYMX-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.79
Rot. Bonds3

About 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide

4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide (PubChem CID 54915908) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide.

Molecular Properties

Compound Name4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide
PubChem CID54915908
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide
SMILESCCN1CCC(NC(=O)c2ccc(N)c(C)c2)CC1
InChIInChI=1S/C15H23N3O/c1-3-18-8-6-13(7-9-18)17-15(19)12-4-5-14(16)11(2)10-12/h4-5,10,13H,3,6-9,16H2,1-2H3,(H,17,19)
InChIKeyUAHQTXPYIZOYMX-UHFFFAOYSA-N
XLogP1.79
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-ethylpiperidin-4-yl)-3,4-dimethylbenzamide
CID 17249701
4-amino-3-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373277
4-amino-N-(1-cyclopropylpiperidin-4-yl)-3-methylbenzamide
CID 43711761
4-amino-N-(1-tert-butylpiperidin-4-yl)-3-methylbenzamide
CID 60945933
4-amino-N-cyclohexyl-3-methylbenzamide
CID 16773559
N-(1-ethylpiperidin-4-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998614
3,5-dibromo-N-(1-ethylpiperidin-4-yl)benzamide
CID 103907480
4-hydroxy-3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 103951674
4-cyano-N-(1-ethylpiperidin-4-yl)benzamide
CID 9091097
N-(1-ethylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249927
3-[(1-ethylpiperidin-4-yl)amino]-N,4-dimethylbenzamide
CID 43726870
ethyl 4-[(4-ethoxy-3-methylbenzoyl)amino]piperidine-1-carboxylate
CID 110762169

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide?
The IUPAC name of 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide (CID 54915908) is 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide.
What is the SMILES notation for 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide?
The canonical SMILES for 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide is CCN1CCC(NC(=O)c2ccc(N)c(C)c2)CC1.
What is the InChIKey of 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide?
The InChIKey is UAHQTXPYIZOYMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-18-8-6-13(7-9-18)17-15(19)12-4-5-14(16)11(2)10-12/h4-5,10,13H,3,6-9,16H2,1-2H3,(H,17,19).
What are the key properties of 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide?
4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide has a molecular weight of 261.37 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethylpiperidin-4-yl)-3-methylbenzamide is sourced from PubChem (CID 54915908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).